ethanedioic acid; 5-nitro-N-(6-piperidin-1-ylhexyl)pyridin-2-amine

Systemtic Name: ethanedioic acid; 5-nitro-N-(6-piperidin-1-ylhexyl)pyridin-2-amine Openeye Name: 5-nitro-N-[6-(1-piperidyl)hexyl]pyridin-2-amine; oxalic acid CAS Name: 5-nitro-N-[6-(1-piperidinyl)hexyl]-2-pyridinamine; oxalic acid IUPAC Name: 5-nitro-N-(6-piperidin-1-ylhexyl)pyridin-2-amine; oxalic acid Traditional Name: (5-nitro-2-pyridyl)-(6-piperidinohexyl)amine; oxalic acid Formula: C18H28N4O6 MolecularWeight: 396.43812

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)CCCCCCNC2=NC=C(C=C2)[N+](=O)[O-].C(=O)(C(=O)O)O

Isomeric SMILES

C1CCN(CC1)CCCCCCNC2=NC=C(C=C2)[N+](=O)[O-].C(=O)(C(=O)O)O

InChI

InChI=1S/C16H26N4O2.C2H2O4/c21-20(22)15-8-9-16(18-14-15)17-10-4-1-2-5-11-19-12-6-3-7-13-19;3-1(4)2(5)6/h8-9,14H,1-7,10-13H2,(H,17,18);(H,3,4)(H,5,6)